6-(1,3-benzothiazol-2-yl)-N-[3-[methyl-(phenylmethyl)amino]propyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: 6-(1,3-benzothiazol-2-yl)-N-[3-[methyl-(phenylmethyl)amino]propyl]cyclohex-3-ene-1-carboxamide Openeye Name: 6-(1,3-benzothiazol-2-yl)-N-[3-[benzyl(methyl)amino]propyl]cyclohex-3-ene-1-carboxamide CAS Name: 6-(1,3-benzothiazol-2-yl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-1-cyclohex-3-enecarboxamide IUPAC Name: 6-(1,3-benzothiazol-2-yl)-N-[3-[benzyl(methyl)amino]propyl]cyclohex-3-ene-1-carboxamide Traditional Name: 6-(1,3-benzothiazol-2-yl)-N-[3-[benzyl(methyl)amino]propyl]cyclohex-3-ene-1-carboxamide Formula: C25H29N3OS MolecularWeight: 419.58226

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1CC=CCC1C2=NC3=CC=CC=C3S2)CC4=CC=CC=C4

Isomeric SMILES

CN(CCCNC(=O)C1CC=CCC1C2=NC3=CC=CC=C3S2)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N3OS/c1-28(18-19-10-3-2-4-11-19)17-9-16-26-24(29)20-12-5-6-13-21(20)25-27-22-14-7-8-15-23(22)30-25/h2-8,10-11,14-15,20-21H,9,12-13,16-18H2,1H3,(H,26,29)